4-(4-chloranyl-2-methyl-phenoxy)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide

Systemtic Name: 4-(4-chloranyl-2-methyl-phenoxy)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide Openeye Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]butanamide CAS Name: 4-(4-chloro-2-methylphenoxy)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide IUPAC Name: 4-(4-chloro-2-methylphenoxy)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]butanamide Traditional Name: 4-(4-chloro-2-methyl-phenoxy)-N-[(6R)-3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]butyramide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CC[C@@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C22H25ClN2O2S/c1-3-15-6-8-17-18(13-24)22(28-20(17)12-15)25-21(26)5-4-10-27-19-9-7-16(23)11-14(19)2/h7,9,11,15H,3-6,8,10,12H2,1-2H3,(H,25,26)/t15-/m1/s1